SCHEMBL9660737

SCHEMBL9660737

O=S(=O)(c1ccccc1)c1ccc(NNC2=NCCS2)c(C(F)(F)F)c1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.41
SFRP1 Q8N474 7/20 0.39
WNT3 P56703 2/20 0.39
POLB P06746 2/20 0.37
ALDH1A1 P00352 2/20 0.37
NPC1 O15118 2/20 0.36
ALOX15 P16050 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
TP53 P04637 1/20 0.36
RAB9A P51151 1/20 0.36
USP2 O75604 1/20 0.35
MEN1 O00255 1/20 0.35
PKM P14618 1/20 0.35
HTR6 P50406 1/20 0.34
ABCC9 O60706 1/20 0.34
ABCC8 Q09428 1/20 0.34
KCNJ11 Q14654 1/20 0.34
KCNJ8 Q15842 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9660140 0.85 NPY1R (0.39) KMT2ANPC1MEN1
SCHEMBL9661605 0.85 KMT2A (0.38) KMT2APOLBALDH1A1NPC1SMN1; SMN2
SCHEMBL9661610 0.77 NPC1 (0.49) KMT2APOLBALDH1A1NPC1SMN1; SMN2
SCHEMBL9658803 0.73 ALDH1A1 (0.37) SFRP1WNT3POLBALDH1A1SMN1; SMN2
SCHEMBL9658808 0.73 ALDH1A1 (0.37) SFRP1WNT3POLBALDH1A1SMN1; SMN2
SCHEMBL9660731 0.73 ALDH1A1 (0.51) KMT2ASFRP1WNT3POLBALDH1A1
SCHEMBL9660817 0.71 KMT2A (0.41) KMT2AALDH1A1NPC1SMN1; SMN2RAB9A
SCHEMBL10841458 0.69 KMT2A (0.51) KMT2APOLBALDH1A1NPC1SMN1; SMN2
SCHEMBL9690711 0.68 POLB (0.41) KMT2APOLBALDH1A1NPC1ALOX15
SCHEMBL9660754 0.67 KIF11 (0.41) KMT2APOLBALDH1A1NPC1SMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0520274-A2 2-(-4-substituted-phenylhydrazino)-2-thiazoline and 2-(-4-substituted phenylazo)-2-thiazoline, their preparation and their use against ectoparasites BAYER AG (DE) 1992-12-30 EP disclosed